Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8tzb_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 4.A N ASN 29.A O no hydrogen 2.881 N/A MET 5.A N LEU 34.A O no hydrogen 3.443 N/A ILE 6.A N TRP 31.A O no hydrogen 2.905 N/A VAL 7.A N LEU 36.A O no hydrogen 2.660 N/A THR 14.A N GLY 11.A O no hydrogen 2.997 N/A THR 14.A OG1 GLY 11.A O no hydrogen 3.072 N/A LEU 16.A N THR 13.A O no hydrogen 3.301 N/A LYS 21.A N VAL 30.A O no hydrogen 2.915 N/A TRP 23.A N LEU 28.A O no hydrogen 2.910 N/A ILE 25.A N LEU 26.A O no hydrogen 3.124 N/A LEU 28.A N TRP 23.A O no hydrogen 2.907 N/A ASN 29.A N MET 2.A O no hydrogen 2.906 N/A VAL 30.A N LYS 21.A O no hydrogen 2.870 N/A TRP 31.A N LEU 4.A O no hydrogen 2.908 N/A ASP 32.A N ASP 19.A O no hydrogen 3.380 N/A PHE 33.A N ILE 6.A O no hydrogen 3.369 N/A TYR 35.A N PRO 49.A O no hydrogen 3.238 N/A LEU 36.A N MET 5.A O no hydrogen 2.959 N/A ALA 37.A N ILE 51.A O no hydrogen 2.690 N/A VAL 38.A N VAL 7.A O no hydrogen 3.060 N/A TYR 39.A N VAL 53.A O no hydrogen 2.758 N/A LEU 47.A N LYS 44.A O no hydrogen 3.029 N/A ILE 51.A N TYR 35.A O no hydrogen 3.166 N/A LEU 52.A N ASP 75.A O no hydrogen 2.880 N/A VAL 53.A N ALA 37.A O no hydrogen 2.867 N/A GLY 54.A N HIS 77.A O no hydrogen 3.115 N/A HIS 56.A N GLY 54.A O no hydrogen 2.922 N/A ASP 58.A N HIS 56.A O no hydrogen 2.592 N/A LYS 64.A N GLU 60.A O no hydrogen 3.102 N/A ALA 65.A N LYS 61.A O no hydrogen 2.911 N/A CYS 66.A N GLN 62.A O no hydrogen 2.898 N/A MET 67.A N ARG 63.A O no hydrogen 2.909 N/A SER 68.A N LYS 64.A O no hydrogen 2.902 N/A LYS 69.A N ALA 65.A O no hydrogen 2.910 N/A ILE 70.A N MET 67.A O no hydrogen 3.395 N/A THR 71.A N MET 67.A O no hydrogen 2.902 N/A LYS 72.A N SER 68.A O no hydrogen 3.178 N/A ARG 74.A N VAL 50.A O no hydrogen 2.830 N/A HIS 77.A N LEU 52.A O no hydrogen 3.168 N/A LEU 91.A N ALA 87.A O no hydrogen 2.861 N/A ARG 92.A N LEU 88.A O no hydrogen 2.891 N/A LYS 93.A N ALA 89.A O no hydrogen 2.898 N/A THR 94.A N LYS 90.A O no hydrogen 2.902 N/A ILE 95.A N LEU 91.A O no hydrogen 2.883 N/A ILE 96.A N ARG 92.A O no hydrogen 2.901 N/A ASN 97.A N LYS 93.A O no hydrogen 2.901 N/A GLU 98.A N THR 94.A O no hydrogen 2.902 N/A SER 99.A N ILE 95.A O no hydrogen 2.888 N/A LEU 100.A N ILE 96.A O no hydrogen 2.906 N/A ASN 101.A N ASN 97.A O no hydrogen 3.051 N/A LYS 106.A N VAL 102.A O no hydrogen 2.809 N/A ILE 107.A N GLU 103.A O no hydrogen 2.909 N/A ILE 108.A N LEU 104.A O no hydrogen 2.901 N/A LEU 109.A N LYS 106.A O no hydrogen 3.329 N/A ARG 112.A N ILE 108.A O no hydrogen 2.894 N/A LYS 113.A N LEU 109.A O no hydrogen 2.817 N/A LYS 113.A NZ LYS 113.A O no hydrogen 2.932 N/A ASN 114.A N ARG 112.A O no hydrogen 2.878 N/A LEU 123.A N ARG 119.A O no hydrogen 3.365 N/A GLN 124.A N LYS 120.A O no hydrogen 2.813 N/A LEU 125.A N LEU 122.A O no hydrogen 2.917 N/A VAL 126.A N LEU 122.A O no hydrogen 2.775 N/A GLN 132.A N ASN 129.A O no hydrogen 3.207 N/A LEU 133.A N GLN 130.A O no hydrogen 2.944 N/A ASP 134.A N LEU 131.A O no hydrogen 2.910 N/A ASN 136.A N LEU 133.A O no hydrogen 2.917 N/A GLU 137.A N ASP 134.A O no hydrogen 3.319 N/A LEU 138.A N ASP 134.A O no hydrogen 3.064 N/A SER 145.A N LEU 142.A O no hydrogen 3.153 N/A VAL 147.A N LEU 142.A O no hydrogen 3.388 N/A HIS 150.A NE2 ALA 141.A O no hydrogen 2.363 N/A MET 165.A N CYS 162.A O no hydrogen 3.237 N/A GLN 166.A N LYS 163.A O no hydrogen 2.905 N/A THR 169.A N GLN 166.A O no hydrogen 2.919 N/A THR 169.A OG1 GLN 166.A O no hydrogen 2.713 N/A MET 175.A N PRO 171.A O no hydrogen 2.734 N/A SER 176.A N LYS 172.A O no hydrogen 2.902 N/A GLN 177.A N ASN 173.A O no hydrogen 2.907 N/A TYR 178.A N TYR 174.A O no hydrogen 2.878 N/A PHE 179.A N MET 175.A O no hydrogen 2.907 N/A LYS 180.A N SER 176.A O no hydrogen 2.926 N/A LEU 181.A N GLN 177.A O no hydrogen 2.876 N/A LEU 182.A N TYR 178.A O no hydrogen 2.877 N/A GLU 183.A N PHE 179.A O no hydrogen 2.944 N/A LYS 184.A N LYS 180.A O no hydrogen 2.895 N/A PHE 185.A N LEU 181.A O no hydrogen 2.593 N/A ILE 187.A N LEU 182.A O no hydrogen 3.164 N/A ALA 188.A N LEU 182.A O no hydrogen 3.487 N/A ASN 209.A ND2 SER 315.A OG no hydrogen 3.404 N/A ASN 209.A ND2 GLU 320.A O no hydrogen 2.890 N/A GLU 211.A N GLU 208.A O no hydrogen 3.011 N/A ILE 212.A N GLU 208.A O no hydrogen 3.256 N/A ILE 213.A N VAL 278.A O no hydrogen 2.844 N/A ARG 215.A N ILE 276.A O no hydrogen 2.914 N/A ARG 215.A NH1 ASP 358.A OD1 no hydrogen 2.475 N/A LEU 216.A N TRP 311.A O no hydrogen 2.882 N/A TYR 217.A N LEU 274.A O no hydrogen 2.847 N/A GLU 218.A N LYS 309.A O no hydrogen 2.859 N/A MET 219.A N SER 272.A O no hydrogen 2.914 N/A PHE 226.A N PRO 223.A O no hydrogen 3.187 N/A TRP 227.A NE1 SER 263.A OG no hydrogen 2.995 N/A ARG 229.A N GLY 225.A O no hydrogen 3.169 N/A LEU 230.A N PHE 226.A O no hydrogen 2.928 N/A ILE 231.A N TRP 227.A O no hydrogen 2.865 N/A ASN 232.A N SER 228.A O no hydrogen 2.918 N/A ARG 233.A N ARG 229.A O no hydrogen 2.925 N/A LEU 234.A N LEU 230.A O no hydrogen 2.743 N/A SER 238.A N GLN 290.A OE1 no hydrogen 2.771 N/A TYR 240.A N SER 238.A OG no hydrogen 3.073 N/A ASN 243.A N ARG 241.A O no hydrogen 2.976 N/A ASN 243.A N ASN 252.A O no hydrogen 3.173 N/A ARG 244.A NH2 LEU 235.A O no hydrogen 2.743 N/A MET 245.A N TYR 250.A O no hydrogen 3.436 N/A ARG 248.A NE SER 196.A O no hydrogen 2.747 N/A ILE 249.A N VAL 261.A O no hydrogen 2.771 N/A TYR 250.A N MET 245.A O no hydrogen 3.269 N/A LEU 251.A N CYS 259.A O no hydrogen 2.979 N/A TRP 253.A N ALA 257.A O no hydrogen 2.910 N/A SER 254.A N ALA 257.A O no hydrogen 3.209 N/A ALA 257.A N SER 254.A O no hydrogen 2.831 N/A CYS 259.A N LEU 251.A O no hydrogen 2.884 N/A CYS 259.A SG LEU 251.A O no hydrogen 3.934 N/A LEU 260.A N THR 277.A O no hydrogen 3.177 N/A GLY 262.A N LYS 275.A O no hydrogen 2.944 N/A GLU 264.A N PHE 273.A O no hydrogen 2.891 N/A ASN 268.A N ASN 268.A OD1 no hydrogen 2.541 N/A SER 272.A N MET 219.A O no hydrogen 2.930 N/A PHE 273.A N GLU 264.A O no hydrogen 2.923 N/A LEU 274.A N TYR 217.A O no hydrogen 2.885 N/A LYS 275.A N GLY 262.A O no hydrogen 2.856 N/A LYS 275.A NZ GLU 264.A OE2 no hydrogen 3.390 N/A ILE 276.A N ARG 215.A O no hydrogen 2.884 N/A VAL 278.A N ILE 213.A O no hydrogen 2.958 N/A SER 280.A N GLU 211.A O no hydrogen 2.575 N/A CYS 281.A SG GLU 256.A O no hydrogen 3.082 N/A ARG 282.A NH1 ARG 282.A O no hydrogen 2.290 N/A LYS 283.A NZ PRO 239.A O no hydrogen 3.087 N/A CYS 285.A SG CYS 281.A O no hydrogen 2.981 N/A ILE 286.A N LYS 283.A O no hydrogen 3.137 N/A LEU 288.A N GLY 284.A O no hydrogen 2.915 N/A GLY 289.A N CYS 285.A O no hydrogen 2.882 N/A GLN 290.A N ILE 286.A O no hydrogen 2.917 N/A GLN 290.A NE2 SER 238.A O no hydrogen 2.735 N/A VAL 291.A N LEU 287.A O no hydrogen 2.869 N/A VAL 292.A N LEU 288.A O no hydrogen 2.916 N/A ASP 293.A N GLY 289.A O no hydrogen 2.890 N/A HIS 294.A N GLN 290.A O no hydrogen 2.870 N/A HIS 294.A NE2 GLU 236.A O no hydrogen 3.125 N/A ILE 295.A N VAL 291.A O no hydrogen 2.908 N/A ASP 296.A N VAL 292.A O no hydrogen 2.915 N/A SER 297.A N ASP 293.A O no hydrogen 2.876 N/A SER 297.A OG ASP 293.A O no hydrogen 3.359 N/A SER 297.A OG HIS 294.A O no hydrogen 2.578 N/A LEU 298.A N HIS 294.A O no hydrogen 2.881 N/A MET 299.A N ILE 295.A O no hydrogen 2.932 N/A GLU 300.A N SER 297.A O no hydrogen 3.357 N/A GLU 301.A N SER 297.A O no hydrogen 2.884 N/A PHE 303.A N LEU 298.A O no hydrogen 3.178 N/A LYS 309.A N GLU 218.A O no hydrogen 2.942 N/A LYS 310.A NZ ASP 296.A OD1 no hydrogen 2.905 N/A LYS 310.A NZ ASP 296.A OD2 no hydrogen 3.364 N/A TRP 311.A N LEU 216.A O no hydrogen 2.873 N/A ALA 312.A N ILE 325.A O no hydrogen 2.905 N/A LEU 313.A N ILE 214.A O no hydrogen 2.953 N/A TYR 314.A N GLN 323.A O no hydrogen 2.903 N/A SER 315.A OG ASN 317.A O no hydrogen 2.505 N/A ASN 317.A N GLU 320.A OE1 no hydrogen 3.184 N/A GLY 319.A N ASP 318.A OD1 no hydrogen 2.751 N/A GLN 323.A N TYR 314.A O no hydrogen 2.919 N/A ILE 325.A N ALA 312.A O no hydrogen 2.928 N/A LEU 327.A N LYS 310.A O no hydrogen 3.287 N/A LEU 330.A N LEU 326.A O no hydrogen 3.280 N/A MET 331.A N LEU 327.A O no hydrogen 2.886 N/A LYS 332.A N ASP 328.A O no hydrogen 2.922 N/A LYS 333.A N ASP 329.A O no hydrogen 2.907 N/A ALA 334.A N LEU 330.A O no hydrogen 2.882 N/A GLU 335.A N MET 331.A O no hydrogen 2.895 N/A GLU 336.A N LYS 332.A O no hydrogen 2.912 N/A GLY 337.A N LYS 333.A O no hydrogen 2.766 N/A LEU 340.A N ILE 350.A O no hydrogen 2.900 N/A ASN 342.A N LEU 348.A O no hydrogen 3.261 N/A ASP 344.A N ASN 342.A OD1 no hydrogen 3.302 N/A ARG 347.A N GLN 345.A O no hydrogen 2.538 N/A ARG 347.A NH1 PRO 346.A O no hydrogen 2.789 N/A THR 349.A OG1 LEU 340.A O no hydrogen 2.700 N/A ILE 350.A N LEU 340.A O no hydrogen 3.033 N/A GLN 354.A N PRO 351.A O no hydrogen 3.084 N/A ILE 355.A N ILE 352.A O no hydrogen 2.798 N/A ALA 356.A N ILE 352.A O no hydrogen 2.768 N/A ASP 358.A N ALA 356.A O no hydrogen 2.678 N/A LEU 359.A N ALA 356.A O no hydrogen 3.288 N/A ILE 368.A N PRO 365.A O no hydrogen 2.890 N/A ASP 373.A N ASN 371.A OD1 no hydrogen 3.213 N/A GLU 376.A N ALA 397.A O no hydrogen 2.700 N/A PHE 383.A N ALA 380.A O no hydrogen 3.163 N/A LEU 385.A N VAL 393.A O no hydrogen 2.866 N/A SER 389.A N GLY 386.A O no hydrogen 3.118 N/A SER 389.A OG GLY 386.A O no hydrogen 2.995 N/A GLY 391.A N GLY 388.A O no hydrogen 3.121 N/A SER 392.A OG ILE 407.A O no hydrogen 2.942 N/A TYR 394.A N VAL 405.A O no hydrogen 2.884 N/A ARG 395.A N PHE 383.A O no hydrogen 3.247 N/A ALA 396.A N VAL 403.A O no hydrogen 2.921 N/A TYR 398.A N GLU 401.A O no hydrogen 3.131 N/A VAL 403.A N ALA 396.A O no hydrogen 2.857 N/A ALA 404.A N MET 444.A O no hydrogen 2.912 N/A VAL 405.A N TYR 394.A O no hydrogen 2.893 N/A LYS 406.A N LEU 442.A O no hydrogen 2.887 N/A ILE 407.A N SER 392.A O no hydrogen 3.207 N/A PHE 408.A N ARG 440.A O no hydrogen 2.901 N/A ARG 412.A NH2 ASP 293.A O no hydrogen 3.555 N/A ARG 415.A N LEU 411.A O no hydrogen 3.152 N/A GLN 416.A N ARG 412.A O no hydrogen 2.949 N/A GLU 417.A N LEU 413.A O no hydrogen 2.916 N/A LEU 418.A N LEU 414.A O no hydrogen 2.898 N/A VAL 419.A N ARG 415.A O no hydrogen 2.926 N/A VAL 420.A N GLN 416.A O no hydrogen 2.964 N/A LEU 421.A N GLU 417.A O no hydrogen 2.880 N/A CYS 422.A N LEU 418.A O no hydrogen 2.875 N/A CYS 422.A SG LEU 418.A O no hydrogen 3.189 N/A HIS 423.A ND1 VAL 419.A O no hydrogen 3.245 N/A LEU 424.A N LEU 421.A O no hydrogen 3.174 N/A SER 428.A N HIS 426.A ND1 no hydrogen 3.016 N/A SER 428.A OG SER 428.A O no hydrogen 2.449 N/A SER 428.A OG HIS 474.A O no hydrogen 2.754 N/A LEU 429.A N HIS 426.A O no hydrogen 3.193 N/A ILE 430.A N ILE 512.A O no hydrogen 3.471 N/A SER 431.A N GLU 445.A OE2 no hydrogen 2.555 N/A SER 431.A OG GLU 445.A OE2 no hydrogen 2.350 N/A LEU 433.A N VAL 443.A O no hydrogen 3.306 N/A ALA 434.A N VAL 443.A O no hydrogen 3.164 N/A ALA 435.A N ILE 368.A O no hydrogen 2.827 N/A ARG 438.A NH2 ASP 338.A OD2 no hydrogen 2.628 N/A ARG 440.A N ILE 437.A O no hydrogen 3.050 N/A MET 441.A N GLY 436.A O no hydrogen 2.784 N/A LEU 442.A N LYS 406.A O no hydrogen 2.901 N/A VAL 443.A N ALA 434.A O no hydrogen 3.330 N/A MET 444.A N ALA 404.A O no hydrogen 2.885 N/A LEU 452.A N VAL 497.A O no hydrogen 2.327 N/A ARG 454.A NE ARG 454.A O no hydrogen 3.216 N/A LEU 455.A N SER 451.A O no hydrogen 3.342 N/A LEU 456.A N LEU 452.A O no hydrogen 2.888 N/A GLN 457.A N ASP 453.A O no hydrogen 3.060 N/A GLN 458.A N ARG 454.A O no hydrogen 3.087 N/A LYS 460.A N GLN 458.A O no hydrogen 2.945 N/A LYS 460.A NZ LEU 456.A O no hydrogen 3.504 N/A SER 462.A N ASP 459.A OD1 no hydrogen 3.357 N/A SER 462.A OG ASP 459.A OD1 no hydrogen 2.563 N/A SER 462.A OG ASP 459.A OD2 no hydrogen 2.989 N/A LEU 463.A N LYS 460.A O no hydrogen 3.263 N/A ARG 465.A NH1 GLN 468.A OE1 no hydrogen 2.572 N/A GLN 468.A N THR 464.A O no hydrogen 3.057 N/A GLN 468.A NE2 ILE 541.A O no hydrogen 2.553 N/A GLN 468.A NE2 LEU 542.A O no hydrogen 3.387 N/A HIS 469.A N ARG 465.A O no hydrogen 2.959 N/A HIS 469.A NE2 LEU 592.A O no hydrogen 2.954 N/A ARG 470.A N THR 466.A O no hydrogen 2.887 N/A ILE 471.A N LEU 467.A O no hydrogen 2.931 N/A ALA 472.A N GLN 468.A O no hydrogen 2.980 N/A LEU 473.A N HIS 469.A O no hydrogen 2.856 N/A HIS 474.A N ARG 470.A O no hydrogen 2.932 N/A HIS 474.A NE2 HIS 908.A NE2 no hydrogen 3.023 N/A VAL 475.A N ILE 471.A O no hydrogen 2.974 N/A ALA 476.A N ALA 472.A O no hydrogen 2.895 N/A ASP 477.A N LEU 473.A O no hydrogen 2.915 N/A GLY 478.A N HIS 474.A O no hydrogen 2.962 N/A LEU 479.A N VAL 475.A O no hydrogen 2.929 N/A ARG 480.A N ALA 476.A O no hydrogen 2.906 N/A ARG 480.A NH2 ASP 477.A OD1 no hydrogen 2.483 N/A TYR 481.A N ASP 477.A O no hydrogen 2.932 N/A TYR 481.A OH HIS 423.A O no hydrogen 3.283 N/A LEU 482.A N GLY 478.A O no hydrogen 2.895 N/A HIS 483.A N LEU 479.A O no hydrogen 2.956 N/A HIS 483.A NE2 ASP 530.A OD2 no hydrogen 2.705 N/A SER 484.A N ARG 480.A O no hydrogen 2.905 N/A SER 484.A OG ARG 480.A O no hydrogen 2.759 N/A ALA 485.A N TYR 481.A O no hydrogen 3.279 N/A MET 486.A N HIS 483.A O no hydrogen 3.073 N/A ILE 487.A N LEU 482.A O no hydrogen 2.936 N/A TYR 489.A N ASP 530.A OD2 no hydrogen 3.083 N/A TYR 489.A OH ALA 513.A O no hydrogen 2.719 N/A LYS 493.A NZ ASP 491.A O no hydrogen 3.156 N/A LYS 493.A NZ ASP 491.A OD1 no hydrogen 3.327 N/A LYS 493.A NZ ASN 496.A OD1 no hydrogen 3.024 N/A ASN 496.A N LYS 493.A O no hydrogen 3.022 N/A ASN 496.A ND2 ALA 513.A O no hydrogen 2.507 N/A VAL 497.A N PRO 494.A O no hydrogen 2.976 N/A LEU 498.A N LYS 511.A O no hydrogen 2.870 N/A LEU 499.A N GLY 450.A O no hydrogen 3.098 N/A PHE 500.A N ILE 509.A O no hydrogen 2.935 N/A THR 501.A OG1 ILE 508.A O no hydrogen 3.344 N/A ALA 506.A N TYR 503.A O no hydrogen 3.108 N/A ILE 509.A N HIS 474.A ND1 no hydrogen 3.189 N/A LYS 511.A N LEU 498.A O no hydrogen 2.910 N/A ILE 512.A N SER 428.A O no hydrogen 3.009 N/A ALA 513.A N ASN 496.A O no hydrogen 2.945 N/A TYR 515.A OH HIS 495.A O no hydrogen 3.183 N/A GLU 523.A N GLU 523.A OE1 no hydrogen 3.279 N/A VAL 524.A N ALA 521.A O no hydrogen 3.237 N/A ASN 526.A ND2 GLU 523.A OE2 no hydrogen 3.269 N/A GLN 527.A N GLN 527.A OE1 no hydrogen 2.523 N/A GLN 528.A NE2 PRO 579.A O no hydrogen 2.305 N/A ALA 529.A N ASN 526.A OD1 no hydrogen 2.912 N/A ASP 530.A N ASN 526.A O no hydrogen 3.368 N/A VAL 531.A N GLN 527.A O no hydrogen 2.910 N/A TYR 532.A N GLN 528.A O no hydrogen 2.919 N/A SER 533.A N ALA 529.A O no hydrogen 2.877 N/A SER 533.A OG PHE 519.A O no hydrogen 3.084 N/A SER 533.A OG ALA 529.A O no hydrogen 3.271 N/A PHE 534.A N ASP 530.A O no hydrogen 2.871 N/A GLY 535.A N VAL 531.A O no hydrogen 2.871 N/A LEU 536.A N TYR 532.A O no hydrogen 2.975 N/A LEU 537.A N SER 533.A O no hydrogen 2.888 N/A LEU 538.A N PHE 534.A O no hydrogen 2.841 N/A TYR 539.A N GLY 535.A O no hydrogen 2.879 N/A TYR 539.A OH PRO 553.A O no hydrogen 2.652 N/A ASP 540.A N LEU 536.A O no hydrogen 2.932 N/A ILE 541.A N LEU 538.A O no hydrogen 3.243 N/A LEU 542.A N LEU 538.A O no hydrogen 2.881 N/A THR 543.A N TYR 539.A O no hydrogen 3.001 N/A ARG 547.A N ASP 540.A OD1 no hydrogen 2.922 N/A LYS 557.A N ASP 554.A O no hydrogen 3.169 N/A GLU 558.A N ASP 554.A O no hydrogen 2.968 N/A CYS 561.A SG LEU 542.A O no hydrogen 4.023 N/A CYS 561.A SG ALA 562.A O no hydrogen 3.470 N/A TRP 564.A N GLU 568.A OE2 no hydrogen 3.138 N/A TRP 564.A NE1 LEU 597.A O no hydrogen 2.256 N/A VAL 567.A N TRP 564.A O no hydrogen 3.349 N/A GLU 568.A N TRP 564.A O no hydrogen 3.417 N/A ILE 571.A N VAL 567.A O no hydrogen 2.890 N/A LYS 572.A N GLU 568.A O no hydrogen 2.891 N/A LYS 572.A NZ ASP 554.A OD2 no hydrogen 3.413 N/A GLN 573.A N LYS 569.A O no hydrogen 2.931 N/A CYS 574.A N LEU 570.A O no hydrogen 2.904 N/A CYS 574.A SG LEU 570.A O no hydrogen 3.403 N/A LEU 575.A N ILE 571.A O no hydrogen 2.962 N/A ASN 578.A ND2 GLU 581.A OE2 no hydrogen 2.698 N/A GLN 580.A N ASN 578.A OD1 no hydrogen 3.426 N/A GLU 581.A N ASN 578.A O no hydrogen 3.036 N/A ARG 582.A NE LYS 576.A O no hydrogen 2.853 N/A ARG 582.A NH1 GLU 523.A OE1 no hydrogen 2.838 N/A ARG 582.A NH1 GLU 523.A OE2 no hydrogen 3.093 N/A ARG 582.A NH2 GLU 523.A OE1 no hydrogen 2.752 N/A THR 584.A N GLN 587.A OE1 no hydrogen 2.800 N/A SER 585.A OG HIS 483.A ND1 no hydrogen 2.990 N/A GLN 587.A N THR 584.A OG1 no hydrogen 3.286 N/A VAL 588.A N THR 584.A O no hydrogen 2.814 N/A PHE 589.A N SER 585.A O no hydrogen 2.931 N/A ASP 590.A N ALA 586.A O no hydrogen 2.921 N/A ILE 591.A N GLN 587.A O no hydrogen 2.894 N/A LEU 592.A N VAL 588.A O no hydrogen 2.926 N/A ASN 593.A N PHE 589.A O no hydrogen 2.559 N/A SER 594.A N LEU 592.A O no hydrogen 2.698 N/A SER 594.A OG GLU 596.A OE1 no hydrogen 2.969 N/A LEU 597.A N SER 594.A O no hydrogen 3.328 N/A CYS 599.A SG ALA 595.A O no hydrogen 3.660 N/A LEU 600.A N GLU 596.A O no hydrogen 3.389 N/A THR 601.A OG1 CYS 599.A O no hydrogen 3.299 N/A ARG 602.A N VAL 893.A O no hydrogen 2.952 N/A ARG 602.A NH2 ASN 640.A O no hydrogen 3.543 N/A ARG 602.A NH2 GLU 642.A OE2 no hydrogen 3.197 N/A ILE 604.A N LEU 891.A O no hydrogen 2.871 N/A LEU 606.A N SER 889.A O no hydrogen 3.204 N/A ASN 609.A N ILE 887.A O no hydrogen 2.949 N/A GLU 613.A N GLY 625.A O no hydrogen 2.928 N/A VAL 616.A N TRP 623.A O no hydrogen 2.911 N/A THR 618.A N SER 621.A O no hydrogen 3.276 N/A THR 618.A OG1 SER 621.A O no hydrogen 3.475 N/A THR 618.A OG1 SER 621.A OG no hydrogen 2.290 N/A SER 621.A OG THR 618.A OG1 no hydrogen 2.290 N/A ILE 622.A N LEU 637.A O no hydrogen 2.885 N/A TRP 623.A N VAL 616.A O no hydrogen 2.891 N/A LEU 624.A N SER 635.A O no hydrogen 2.880 N/A GLY 625.A N CYS 614.A O no hydrogen 2.840 N/A CYS 626.A N GLN 633.A O no hydrogen 2.915 N/A CYS 626.A SG SER 635.A OG no hydrogen 2.756 N/A CYS 626.A SG TYR 644.A OH no hydrogen 3.353 N/A GLY 627.A N ILE 611.A O no hydrogen 2.370 N/A ASP 630.A N THR 629.A OG1 no hydrogen 2.637 N/A ARG 631.A NH1 ASP 651.A O no hydrogen 3.484 N/A GLY 632.A N ALA 650.A O no hydrogen 2.888 N/A LEU 634.A N GLU 647.A O no hydrogen 2.841 N/A SER 635.A N LEU 624.A O no hydrogen 2.885 N/A SER 635.A OG TYR 644.A OH no hydrogen 3.099 N/A PHE 636.A N THR 645.A O no hydrogen 2.822 N/A LEU 637.A N ILE 622.A O no hydrogen 2.891 N/A ASN 640.A N ASP 638.A OD1 no hydrogen 3.159 N/A TYR 644.A N GLU 642.A O no hydrogen 3.050 N/A TYR 644.A OH SER 635.A OG no hydrogen 3.099 N/A THR 645.A N PHE 636.A O no hydrogen 3.111 N/A THR 645.A OG1 PHE 636.A O no hydrogen 3.549 N/A GLU 647.A N LEU 634.A O no hydrogen 3.161 N/A VAL 649.A N GLY 632.A O no hydrogen 2.814 N/A ALA 650.A N GLY 632.A O no hydrogen 2.920 N/A SER 652.A OG ASP 651.A OD1 no hydrogen 3.088 N/A ARG 653.A NE THR 629.A O no hydrogen 3.342 N/A LEU 655.A N GLY 673.A O no hydrogen 2.642 N/A CYS 656.A N GLY 673.A O no hydrogen 2.969 N/A CYS 656.A SG GLY 673.A O no hydrogen 3.711 N/A CYS 656.A SG VAL 700.A O no hydrogen 3.249 N/A ALA 658.A N VAL 671.A O no hydrogen 2.934 N/A VAL 660.A N TRP 669.A O no hydrogen 2.857 N/A LEU 662.A N GLU 667.A O no hydrogen 2.865 N/A GLU 667.A N LEU 662.A O no hydrogen 2.931 N/A TRP 669.A N VAL 660.A O no hydrogen 2.927 N/A TRP 669.A NE1 GLU 667.A OE1 no hydrogen 2.581 N/A ILE 670.A N ILE 682.A O no hydrogen 2.876 N/A VAL 671.A N ALA 658.A O no hydrogen 2.868 N/A SER 672.A N LEU 680.A O no hydrogen 2.873 N/A GLY 673.A N CYS 656.A O no hydrogen 2.867 N/A THR 674.A OG1 THR 678.A O no hydrogen 2.911 N/A GLN 675.A N ARG 653.A O no hydrogen 2.847 N/A SER 676.A OG THR 678.A OG1 no hydrogen 2.955 N/A GLY 677.A N THR 674.A O no hydrogen 3.289 N/A THR 678.A N THR 674.A OG1 no hydrogen 3.069 N/A THR 678.A OG1 SER 676.A OG no hydrogen 2.955 N/A LEU 680.A N SER 672.A O no hydrogen 2.907 N/A VAL 681.A N HIS 691.A O no hydrogen 2.883 N/A ILE 682.A N ILE 670.A O no hydrogen 2.900 N/A ASN 683.A N LYS 689.A O no hydrogen 3.096 N/A THR 684.A N SER 668.A O no hydrogen 2.920 N/A GLU 685.A N ASN 683.A OD1 no hydrogen 3.158 N/A LYS 689.A N ASP 686.A OD1 no hydrogen 3.077 N/A HIS 691.A N VAL 681.A O no hydrogen 2.908 N/A HIS 691.A NE2 VAL 724.A O no hydrogen 3.090 N/A LEU 693.A N LEU 679.A O no hydrogen 3.150 N/A GLU 694.A N ALA 729.A O no hydrogen 2.993 N/A LYS 695.A NZ SER 676.A O no hydrogen 2.838 N/A MET 696.A N GLY 677.A O no hydrogen 2.820 N/A THR 697.A OG1 ASP 713.A OD2 no hydrogen 3.282 N/A SER 699.A N ASP 698.A OD1 no hydrogen 2.804 N/A SER 699.A OG GLN 675.A O no hydrogen 2.715 N/A SER 699.A OG ASP 698.A OD1 no hydrogen 3.562 N/A VAL 700.A N THR 674.A O no hydrogen 3.135 N/A THR 701.A N GLY 710.A O no hydrogen 2.896 N/A THR 701.A OG1 GLY 710.A O no hydrogen 3.489 N/A THR 701.A OG1 THR 711.A O no hydrogen 3.267 N/A THR 701.A OG1 LEU 743.A O no hydrogen 2.848 N/A CYS 702.A N GLY 710.A O no hydrogen 3.262 N/A CYS 702.A SG MET 744.A O no hydrogen 3.349 N/A TYR 704.A N LEU 708.A O no hydrogen 3.046 N/A TYR 704.A OH GLU 748.A OE1 no hydrogen 2.252 N/A LEU 707.A N PHE 719.A O no hydrogen 2.789 N/A LEU 708.A N TYR 704.A O no hydrogen 2.680 N/A VAL 709.A N ALA 717.A O no hydrogen 2.996 N/A GLY 710.A N CYS 702.A O no hydrogen 2.769 N/A ASP 713.A N THR 711.A OG1 no hydrogen 3.146 N/A LYS 715.A N THR 711.A OG1 no hydrogen 3.210 N/A ALA 717.A N VAL 709.A O no hydrogen 2.913 N/A ILE 718.A N LYS 733.A O no hydrogen 2.990 N/A PHE 719.A N LEU 707.A O no hydrogen 2.737 N/A THR 723.A N GLU 720.A O no hydrogen 2.998 N/A THR 723.A OG1 GLU 720.A O no hydrogen 3.190 N/A LYS 725.A NZ GLU 665.A OE1 no hydrogen 2.886 N/A LYS 725.A NZ GLU 665.A OE2 no hydrogen 3.562 N/A LEU 726.A N THR 723.A O no hydrogen 3.078 N/A GLY 728.A N THR 692.A O no hydrogen 2.678 N/A LEU 732.A N ILE 718.A O no hydrogen 3.105 N/A LEU 735.A N LEU 716.A O no hydrogen 2.941 N/A ILE 737.A N GLY 714.A O no hydrogen 3.224 N/A ASN 739.A ND2 VAL 740.A O no hydrogen 2.812 N/A THR 741.A OG1 ASN 739.A OD1 no hydrogen 2.802 N/A LEU 743.A N THR 711.A O no hydrogen 2.945 N/A MET 744.A N GLY 754.A O no hydrogen 3.118 N/A CYS 745.A N GLY 754.A O no hydrogen 3.006 N/A CYS 745.A SG GLY 754.A O no hydrogen 3.991 N/A CYS 745.A SG ILE 790.A O no hydrogen 3.305 N/A SER 747.A N TRP 752.A O no hydrogen 2.885 N/A SER 747.A OG GLU 748.A O no hydrogen 3.290 N/A GLU 748.A N GLU 748.A OE1 no hydrogen 2.964 N/A MET 751.A N PHE 762.A O no hydrogen 2.914 N/A TRP 752.A N SER 747.A O no hydrogen 2.937 N/A TRP 752.A NE1 SER 749.A O no hydrogen 3.050 N/A GLY 753.A N PHE 760.A O no hydrogen 2.888 N/A GLY 754.A N CYS 745.A O no hydrogen 2.892 N/A CYS 755.A N LYS 758.A O no hydrogen 2.935 N/A GLY 756.A N PRO 742.A O no hydrogen 3.093 N/A LYS 758.A N CYS 755.A O no hydrogen 2.872 N/A ILE 759.A N ILE 772.A O no hydrogen 2.875 N/A PHE 760.A N GLY 753.A O no hydrogen 2.905 N/A SER 761.A N LYS 770.A O no hydrogen 2.931 N/A PHE 762.A N MET 751.A O no hydrogen 2.955 N/A PHE 766.A N SER 763.A O no hydrogen 2.883 N/A THR 767.A N ASP 765.A OD1 no hydrogen 2.994 N/A GLN 769.A N SER 761.A O no hydrogen 2.857 N/A ILE 772.A N ILE 759.A O no hydrogen 2.869 N/A THR 774.A N THR 757.A O no hydrogen 2.793 N/A THR 774.A OG1 THR 757.A O no hydrogen 2.310 N/A ARG 775.A NE ASP 787.A OD1 no hydrogen 3.061 N/A PHE 785.A N TYR 782.A O no hydrogen 3.058 N/A SER 786.A N TYR 782.A O no hydrogen 3.516 N/A SER 786.A OG SER 777.A O no hydrogen 2.935 N/A SER 786.A OG SER 781.A O no hydrogen 3.550 N/A ASP 787.A N ALA 783.A O no hydrogen 3.422 N/A SER 788.A N PHE 785.A O no hydrogen 3.238 N/A SER 788.A OG PHE 785.A O no hydrogen 2.465 N/A SER 788.A OG GLN 804.A O no hydrogen 2.974 N/A ILE 791.A N ALA 802.A O no hydrogen 2.827 N/A THR 792.A N ALA 802.A O no hydrogen 2.970 N/A VAL 794.A N TYR 800.A O no hydrogen 2.923 N/A LEU 799.A N TRP 812.A O no hydrogen 2.872 N/A TYR 800.A N VAL 794.A O no hydrogen 2.895 N/A ILE 801.A N GLU 810.A O no hydrogen 2.887 N/A ALA 802.A N THR 792.A O no hydrogen 2.899 N/A LYS 803.A NZ THR 774.A O no hydrogen 3.291 N/A LYS 803.A NZ THR 774.A OG1 no hydrogen 2.951 N/A LYS 803.A NZ SER 786.A O no hydrogen 2.630 N/A GLN 804.A N ASN 789.A O no hydrogen 2.701 N/A SER 806.A OG VAL 808.A O no hydrogen 3.289 N/A VAL 808.A N SER 806.A OG no hydrogen 3.312 N/A VAL 809.A N ILE 820.A O no hydrogen 2.802 N/A GLU 810.A N ILE 801.A O no hydrogen 2.931 N/A TRP 812.A N LEU 799.A O no hydrogen 2.905 N/A GLU 817.A N ASP 813.A O no hydrogen 3.191 N/A ILE 820.A N VAL 809.A O no hydrogen 2.576 N/A CYS 822.A N PRO 807.A O no hydrogen 2.997 N/A VAL 823.A N ASP 821.A OD1 no hydrogen 3.287 N/A LEU 826.A N CYS 822.A O no hydrogen 2.924 N/A ARG 827.A N VAL 823.A O no hydrogen 2.866 N/A GLU 828.A N HIS 824.A O no hydrogen 2.949 N/A VAL 829.A N PHE 825.A O no hydrogen 3.117 N/A ARG 833.A NE SER 831.A O no hydrogen 3.055 N/A VAL 834.A N SER 806.A O no hydrogen 2.967 N/A LYS 835.A N GLY 845.A O no hydrogen 2.852 N/A LYS 835.A NZ ASN 805.A OD1 no hydrogen 3.315 N/A THR 836.A N GLY 845.A O no hydrogen 2.952 N/A THR 836.A OG1 LEU 837.A O no hydrogen 3.376 N/A THR 836.A OG1 MET 872.A O no hydrogen 3.477 N/A CYS 838.A N TRP 843.A O no hydrogen 2.896 N/A CYS 838.A SG LEU 839.A O no hydrogen 3.988 N/A GLN 840.A N ALA 841.A O no hydrogen 3.033 N/A GLN 840.A NE2 ILE 896.A O no hydrogen 3.654 N/A LEU 842.A N LEU 854.A O no hydrogen 2.900 N/A TRP 843.A N CYS 838.A O no hydrogen 2.917 N/A ILE 844.A N LEU 852.A O no hydrogen 2.902 N/A GLY 845.A N THR 836.A O no hydrogen 2.883 N/A THR 846.A N HIS 850.A O no hydrogen 3.139 N/A GLY 847.A N ARG 833.A O no hydrogen 2.730 N/A GLY 849.A N THR 846.A O no hydrogen 3.413 N/A ILE 851.A N VAL 864.A O no hydrogen 2.916 N/A LEU 852.A N ILE 844.A O no hydrogen 2.881 N/A LEU 853.A N ARG 863.A O no hydrogen 3.033 N/A LEU 854.A N LEU 842.A O no hydrogen 2.898 N/A ASP 855.A N ARG 860.A O no hydrogen 3.324 N/A SER 857.A N ASP 855.A OD2 no hydrogen 3.090 N/A THR 858.A OG1 THR 858.A O no hydrogen 2.510 N/A ILE 862.A N LEU 853.A O no hydrogen 2.956 N/A SER 868.A OG TYR 885.A O no hydrogen 3.335 N/A ARG 870.A N LEU 883.A O no hydrogen 2.272 N/A ARG 870.A NE GLU 613.A O no hydrogen 2.965 N/A VAL 871.A N LEU 883.A O no hydrogen 3.000 N/A MET 872.A N THR 836.A OG1 no hydrogen 3.266 N/A MET 873.A N LEU 881.A O no hydrogen 2.911 N/A ALA 875.A N VAL 879.A O no hydrogen 2.899 N/A VAL 879.A N ALA 875.A O no hydrogen 2.912 N/A MET 880.A N TRP 894.A O no hydrogen 2.887 N/A LEU 881.A N MET 873.A O no hydrogen 2.886 N/A VAL 882.A N THR 892.A O no hydrogen 2.906 N/A LEU 883.A N VAL 871.A O no hydrogen 2.847 N/A GLY 884.A N CYS 890.A O no hydrogen 2.915 N/A TYR 885.A N SER 868.A OG no hydrogen 2.284 N/A TYR 885.A OH VAL 612.A O no hydrogen 2.177 N/A ASN 886.A ND2 GLN 888.A O no hydrogen 2.693 N/A GLN 888.A N ASN 886.A O no hydrogen 2.938 N/A GLN 888.A NE2 LEU 606.A O no hydrogen 2.284 N/A GLN 888.A NE2 SER 889.A O no hydrogen 2.806 N/A SER 889.A OG VAL 610.A O no hydrogen 2.792 N/A CYS 890.A N GLY 884.A O no hydrogen 2.878 N/A CYS 890.A SG THR 892.A OG1 no hydrogen 3.736 N/A LEU 891.A N ILE 604.A O no hydrogen 2.914 N/A THR 892.A N VAL 882.A O no hydrogen 2.860 N/A VAL 893.A N ARG 602.A O no hydrogen 2.886 N/A TRP 894.A N MET 880.A O no hydrogen 2.905 N/A ASP 895.A N CYS 599.A O no hydrogen 2.925 N/A ILE 896.A N ASN 878.A O no hydrogen 3.147 N/A ASN 897.A N ASP 895.A OD1 no hydrogen 3.300 N/A LEU 898.A N ASP 895.A O no hydrogen 2.860 N/A HIS 900.A N ASN 897.A O no hydrogen 2.781 N/A GLU 901.A N ASN 897.A O no hydrogen 2.964 N/A VAL 902.A N LEU 898.A O no hydrogen 3.450 N/A GLN 903.A NE2 PRO 899.A O no hydrogen 2.994 N/A ASN 904.A N HIS 900.A O no hydrogen 3.061 N/A LEU 905.A N GLU 901.A O no hydrogen 3.072 N/A GLU 906.A N VAL 902.A O no hydrogen 3.328 N/A LYS 907.A N GLN 903.A O no hydrogen 3.073 N/A HIS 908.A N ASN 904.A O no hydrogen 2.558 N/A HIS 908.A NE2 HIS 474.A NE2 no hydrogen 3.023 N/A ILE 909.A N LEU 905.A O no hydrogen 2.940 N/A VAL 911.A N LYS 907.A O no hydrogen 2.860 N/A ARG 912.A N HIS 908.A O no hydrogen 2.884 N/A ARG 912.A NH2 ALA 507.A O no hydrogen 3.428 N/A LYS 913.A N ILE 909.A O no hydrogen 2.575 N/A LYS 913.A NZ GLU 917.A OE2 no hydrogen 2.596 N/A GLU 914.A N GLU 910.A O no hydrogen 2.816 N/A LEU 915.A N VAL 911.A O no hydrogen 3.164 N/A ALA 916.A N ARG 912.A O no hydrogen 3.393 N/A GLU 917.A N LYS 913.A O no hydrogen 2.909 N/A LYS 918.A N GLU 914.A O no hydrogen 2.920 N/A LYS 918.A N LEU 915.A O no hydrogen 2.930 N/A LYS 918.A NZ GLU 914.A OE2 no hydrogen 3.339 N/A MET 919.A N LEU 915.A O no hydrogen 2.775 N/A MET 919.A N ALA 916.A O no hydrogen 2.932 N/A ARG 920.A N ALA 916.A O no hydrogen 2.755 N/A